1-[(R)-(4-fluorophenyl)-[1-[[(2R)-oxolan-2-yl]methyl]-1,2,3,4-tetrazol-5-yl]methyl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(R)-(4-fluorophenyl)-[1-[[(2R)-oxolan-2-yl]methyl]-1,2,3,4-tetrazol-5-yl]methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(R)-(4-fluorophenyl)-[1-[[(2R)-tetrahydrofuran-2-yl]methyl]tetrazol-5-yl]methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(R)-(4-fluorophenyl)-[1-[[(2R)-2-oxolanyl]methyl]-5-tetrazolyl]methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(R)-(4-fluorophenyl)-[1-[[(2R)-oxolan-2-yl]methyl]tetrazol-5-yl]methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(R)-(4-fluorophenyl)-[1-[[(2R)-tetrahydrofuran-2-yl]methyl]tetrazol-5-yl]methyl]-4-phenyl-piperazin-1-ium Formula: C23H28FN6O+ MolecularWeight: 423.506423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=N2)C(C3=CC=C(C=C3)F)[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=NN=N2)[C@@H](C3=CC=C(C=C3)F)[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C23H27FN6O/c24-19-10-8-18(9-11-19)22(23-25-26-27-30(23)17-21-7-4-16-31-21)29-14-12-28(13-15-29)20-5-2-1-3-6-20/h1-3,5-6,8-11,21-22H,4,7,12-17H2/p+1/t21-,22-/m1/s1